Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.60 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | RGS12 | O14924 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3247294 | 0.90 | PTGS2 (0.68) | PTGS2PLA2G2ATSHRMAPK1KMT2A | |
| SCHEMBL6652438 | 0.90 | PTGS2 (0.68) | PTGS2PLA2G2ATSHRMAPK1KMT2A | |
| SCHEMBL8877519 | 0.89 | PTGS2 (0.63) | PTGS2PLA2G2ATSHRMAPK1KMT2A | |
| SCHEMBL8876865 | 0.88 | PTGS2 (0.60) | PTGS2PLA2G2ATSHRMAPK1KMT2A | |
| SCHEMBL8876344 | 0.88 | PTGS2 (0.55) | PTGS2PLA2G2ATSHRMAPK1KMT2A | |
| SCHEMBL8879445 | 0.86 | PTGS2 (0.65) | PTGS2PLA2G2ATSHRMAPK1KMT2A | |
| SCHEMBL8878199 | 0.85 | PTGS2 (0.59) | PTGS2PLA2G2ATSHRMAPK1KMT2A | |
| SCHEMBL8876060 | 0.85 | PTGS2 (0.59) | PTGS2PLA2G2ATSHRMAPK1KMT2A | |
| SCHEMBL8878258 | 0.84 | PTGS2 (0.63) | PTGS2PLA2G2ATSHRMAPK1KMT2A | |
| SCHEMBL8878338 | 0.84 | PTGS2 (0.66) | PTGS2PLA2G2ATSHRMAPK1KMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5604253-A | ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS | MERCK FROSST CANADA, INC. (CA) | 1997-02-18 | — | — | US | disclosed |
| WO-1996037469-A1 | N-BENZYLINDOL-3-YL PROPANIC ACID DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 1996-11-28 | — | — | WO | disclosed |